CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00159052" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

Search Results

CFAM Mol ID CFAMM00159052
Family CFFCD464 5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Ligand PD-158771 Family
Superfamily CFSCD424 5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Ligand PD-158771 Superfamily
Class CFCCD305 Class 1118
External ID CHEMBL1683139 External Source CHEMBL
PubChem CID 53322825 Functional Category Bioactive
Molecule Name (1R)-2-(2,5-difluorophenyl)-1-(1-pyrimidin-2-ylpiperidin-4-yl)ethanamine
IUPAC Name (1R)-2-(2,5-difluorophenyl)-1-(1-pyrimidin-2-ylpiperidin-4-yl)ethanamine
Synonyms CHEBI:1173224
InChi InChI=1S/C17H20F2N4/c18-14-2-3-15(19)13(10-14)11-16(20)12-4-8-23(9-5-12)17-21-6-1-7-22-17/h1-3,6-7,10,12,16H,4-5,8-9,11,20H2/t16-/m1/s1
InChiKey AXNVOZYZWQKYNZ-MRXNPFEDSA-N
Formula C17H20F2N4 Molecular Weight 318.36
Cross Link CHEMBL1683139
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

26815 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00159052'),None, txtsearch, CFAMM00159052|